4-[3-(3-chloranyl-4-cyano-phenyl)-5,5-dimethyl-4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-N-propyl-piperidine-1-carboxamide

Systemtic Name: 4-[3-(3-chloranyl-4-cyano-phenyl)-5,5-dimethyl-4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-N-propyl-piperidine-1-carboxamide Openeye Name: 4-[3-(3-chloro-4-cyano-phenyl)-5,5-dimethyl-4-oxo-2-thioxo-imidazolidin-1-yl]-N-propyl-piperidine-1-carboxamide CAS Name: 4-[3-(3-chloro-4-cyanophenyl)-5,5-dimethyl-4-oxo-2-sulfanylidene-1-imidazolidinyl]-N-propyl-1-piperidinecarboxamide IUPAC Name: 4-[3-(3-chloro-4-cyanophenyl)-5,5-dimethyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]-N-propylpiperidine-1-carboxamide Traditional Name: 4-[3-(3-chloro-4-cyano-phenyl)-4-keto-5,5-dimethyl-2-thioxo-imidazolidin-1-yl]-N-propyl-piperidine-1-carboxamide Formula: C21H26ClN5O2S MolecularWeight: 447.98144

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCC(CC1)N2C(=S)N(C(=O)C2(C)C)C3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CCCNC(=O)N1CCC(CC1)N2C(=S)N(C(=O)C2(C)C)C3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C21H26ClN5O2S/c1-4-9-24-19(29)25-10-7-15(8-11-25)27-20(30)26(18(28)21(27,2)3)16-6-5-14(13-23)17(22)12-16/h5-6,12,15H,4,7-11H2,1-3H3,(H,24,29)